SCHEMBL10403434

SCHEMBL10403434

CN(C)CCc1nnc(SC[C]=O)s1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10403137 0.84 KMT2A (0.37) KMT2A
SCHEMBL10403614 0.76 ALDH1A1 (0.32) KDM4EALDH1A1
SCHEMBL10767746 0.76 — —
SCHEMBL10403061 0.75 KDM4E (0.40) KDM4EALDH1A1
SCHEMBL10403063 0.75 KDM4E (0.40) KDM4EALDH1A1
SCHEMBL10767752 0.73 — —
SCHEMBL10401908 0.72 KDM4E (0.41) KDM4EALDH1A1
SCHEMBL12263493 0.66 NPC1 (0.36) KDM4EALDH1A1
SCHEMBL10401930 0.65 KDM4E (0.35) KDM4E
SCHEMBL1241982 0.65 TAAR1 (0.36) KMT2AKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4914206-A ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-04-03 — — US disclosed
EP-0226896-A2 Lankacidin derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1987-07-01 — — EP disclosed
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